N-(4-chlorophenyl)-2-[4-[1-(2-methylpropyl)benzimidazol-2-yl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-chlorophenyl)-2-[4-[1-(2-methylpropyl)benzimidazol-2-yl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-chlorophenyl)-2-[4-(1-isobutylbenzimidazol-2-yl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-chlorophenyl)-2-[4-[1-(2-methylpropyl)-2-benzimidazolyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-chlorophenyl)-2-[4-[1-(2-methylpropyl)benzimidazol-2-yl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-chlorophenyl)-2-[4-(1-isobutylbenzimidazol-2-yl)piperazin-1-ium-1-yl]acetamide Formula: C23H29ClN5O+ MolecularWeight: 426.96226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1N3CC[NH+](CC3)CC(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C1N3CC[NH+](CC3)CC(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H28ClN5O/c1-17(2)15-29-21-6-4-3-5-20(21)26-23(29)28-13-11-27(12-14-28)16-22(30)25-19-9-7-18(24)8-10-19/h3-10,17H,11-16H2,1-2H3,(H,25,30)/p+1